Geometry & MOs

Info

ID:	9415
PubChem CID:	89398
Reduced:	O3C24H34 (1)
Stoich.:	A3B24C34 (1)
Weight, g/mol:	370.250795
ΔH_f, kcal/mol:	-139.22
Dipole, Da:	2.59
IP(EA), eV:	-9.03(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(17-acetyl-6,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate

Drug info:

PubChemData

Smile

CC1=C2CC(CCC2(C3CCC4(C(C3C1)CC=C4C(=O)C)C)C)OC(=O)C

DOS

IR

Vibrations